SCHEMBL22817899

SCHEMBL22817899

CN(C)C1CCN(c2ncc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2-c2ccns2)C1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 20/20 0.65
▸ KCNH2 Q12809 2/20 0.60
▸ BCR P11274 1/20 0.60
▸ CRBN Q96SW2 1/20 0.60

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20419084 1.00 ABL1 (0.65) ABL1KCNH2BCRCRBN
SCHEMBL21480436 0.94 ABL1 (0.60) ABL1KCNH2BCRCRBN
SCHEMBL20419089 0.90 ABL1 (0.65) ABL1KCNH2BCRCRBN
SCHEMBL22817900 0.90 ABL1 (0.65) ABL1KCNH2BCRCRBN
SCHEMBL20419081 0.90 ABL1 (0.74) ABL1KCNH2BCRCRBN
SCHEMBL22817901 0.90 ABL1 (0.74) ABL1KCNH2BCRCRBN
SCHEMBL20419057 0.88 ABL1 (0.63) ABL1KCNH2
SCHEMBL20419091 0.87 ABL1 (0.64) ABL1KCNH2
SCHEMBL22817898 0.87 ABL1 (0.64) ABL1KCNH2
SCHEMBL29489958 0.87 ABL1 (0.52) ABL1KCNH2BCRCRBN

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10875853-B2 (Hetero)arylamide compound for inhibiting protein kinase activity SHENZHEN TARGETRX, INC. (CN) 2020-12-29 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10875853-B2 (Hetero)arylamide compound for inhibiting protein kinase activity MAP2K2, MAP2K5, MAP2K4 ABL1 45/4885KCNH2 941/4885BCR 973/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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